SCHEMBL130896

SCHEMBL130896

CNC1CCOc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.52
HTR2A P28223 1/20 0.44
ITGB2 P05107 1/20 0.43
ICAM1 P05362 1/20 0.43
ITGAL P20701 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22997177 1.00 PDPK1 (0.52) PDPK1HTR2AITGB2ICAM1ITGAL
SCHEMBL7500388 1.00 PDPK1 (0.52) PDPK1HTR2AITGB2ICAM1ITGAL
SCHEMBL29858433 1.00 PDPK1 (0.52) PDPK1HTR2AITGB2ICAM1ITGAL
SCHEMBL5017486 0.84 ITGB2 (0.46) HTR2AITGB2ICAM1ITGAL
SCHEMBL6431777 0.84 ITGB2 (0.46) HTR2AITGB2ICAM1ITGAL
SCHEMBL18215053 0.81 ITGB2 (0.43) HTR2AITGB2ICAM1ITGAL
SCHEMBL12162969 0.81 ITGB2 (0.43) HTR2AITGB2ICAM1ITGAL
SCHEMBL2790683 0.81 ITGB2 (0.43) HTR2AITGB2ICAM1ITGAL
SCHEMBL5019354 0.80 HTR2A (0.50) HTR2AITGB2ICAM1ITGAL
SCHEMBL31595597 0.80 HTR2A (0.50) HTR2AITGB2ICAM1ITGAL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 97 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150339-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2024-05-09 US disclosed
EP-4291557-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2023-12-20 EP disclosed
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-11-09 US disclosed
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-11-09 US disclosed
CN-116848107-A Compounds and their use as PDE4 activators 米罗尼德有限公司 2023-10-03 CN disclosed
US-11731981-B2 CCR2 receptor antagonists and uses thereof CENTREXION THERAPEUTICS CORPORATION (US) 2023-08-22 US disclosed
WO-2023107356-A1 ANTIMALARIAL AGENTS MERCK SHARP & DOHME LLC (US) 2023-06-15 WO disclosed
WO-2023102747-A1 ANTIMALARIAL AGENTS MERCK SHARP & DOHME LLC (US) 2023-06-15 WO disclosed
US-20230139282-A1 ANTIMALARIAL AGENTS MERCK SHARP & DOHME LLC (US) 2023-05-04 US disclosed
US-20230139282-A1 ANTIMALARIAL AGENTS MERCK SHARP & DOHME LLC (US) 2023-05-04 US disclosed
EP-1512397-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-09 EP disclosed
EP-1510207-A1 THERAPEUTIC DRUG FOR DIABETES Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-02 EP disclosed
EP-1510210-A1 IMMUNITY-RELATED PROTEIN KINASE INHIBITORS Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-02 EP disclosed
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2004-12-23 US disclosed
CN-1489458-A Inflammatory cytokine production dissociation inhibitor ��ʽ����ҽҩ��������о��� 2004-04-14 CN disclosed
EP-1352650-A1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES Institute of Medicinal Molecular Design, Inc. (JP) 2003-10-15 EP disclosed
EP-1192146-A1 CHROMAN DERIVATIVES RESISTING NEUROLOGICAL DISORDERS AstraZeneca UK Limited (GB) 2002-04-03 EP disclosed
WO-2000078742-A1 CHROMAN DERIVATIVES AGAINST NEUROLOGICAL DISORDERS ASTRAZENECA UK LIMITED (GB) 2000-12-28 WO disclosed
EP-0808303-A1 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST ZENECA LIMITED (GB) 1997-11-26 EP disclosed
WO-1996024582-A1 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST ZENECA LIMITED (GB) 1996-08-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230139282-A1 ANTIMALARIAL AGENTS G6PD, MTX1, OAT PDPK1 2929/4885HTR2A 4669/4885ITGB2 2103/4885
US-11731981-B2 CCR2 receptor antagonists and uses thereof CCR2, CCRL2, CCR1 PDPK1 3375/4885HTR2A 635/4885ITGB2 591/4885
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS CTSL, PRCP, CPB1 PDPK1 1711/4885HTR2A 4790/4885ITGB2 1989/4885
US-20240150339-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE4B, PDE4C PDPK1 313/4885HTR2A 1772/4885ITGB2 4315/4885
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines NFKBIA, IL1B, IKBKB PDPK1 2678/4885HTR2A 3135/4885ITGB2 1242/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.